CID 131302460

2-cyclopropyl-2-ethoxyethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO3S
SMILES
CCOC(CS(=O)(=O)Cl)C1CC1
InChI
InChI=1S/C7H13ClO3S/c1-2-11-7(6-3-4-6)5-12(8,9)10/h6-7H,2-5H2,1H3
InChIKey
NEGTVBXNDXKLFT-UHFFFAOYSA-N
Compound name
2-cyclopropyl-2-ethoxyethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.02739 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.03467 145.8
[M+Na]+ 235.01661 156.7
[M+NH4]+ 230.06121 153.9
[M+K]+ 250.99055 151.7
[M-H]- 211.02011 151.8
[M+Na-2H]- 233.00206 151.3
[M]+ 212.02684 150.7
[M]- 212.02794 150.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.